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- import pandas as pd
- import numpy as np
- from sklearn.linear_model import LinearRegression
- from sklearn.ensemble import RandomForestRegressor
- from sklearn.metrics import mean_squared_error
- import math
- def main():
- df_train = pd.read_csv("train.csv")
- df_test = pd.read_csv("test.csv")
- df_train[["gap", "smiles"]].to_csv("train_gap.csv")
- df_test[["smiles"]].to_csv("test_gap.csv")
- main()
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